3,3-dimethoxy-5-nitro-2H-isoindol-1-one

Systemtic Name: 3,3-dimethoxy-5-nitro-2H-isoindol-1-one Openeye Name: 3,3-dimethoxy-5-nitro-isoindolin-1-one CAS Name: 3,3-dimethoxy-5-nitro-2H-isoindol-1-one IUPAC Name: 3,3-dimethoxy-5-nitro-2H-isoindol-1-one Traditional Name: 3,3-dimethoxy-5-nitro-isoindolin-1-one Formula: C10H10N2O5 MolecularWeight: 238.1968

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Descriptors Computed from Structure

Canonical SMILES:

COC1(C2=C(C=CC(=C2)[N+](=O)[O-])C(=O)N1)OC

Isomeric SMILES

COC1(C2=C(C=CC(=C2)[N+](=O)[O-])C(=O)N1)OC

InChI

InChI=1S/C10H10N2O5/c1-16-10(17-2)8-5-6(12(14)15)3-4-7(8)9(13)11-10/h3-5H,1-2H3,(H,11,13)